3-(4-chlorophenyl)sulfanyl-4-[(3-methoxyphenyl)amino]-1-phenethyl-pyrrole-2,5-dione

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-4-[(3-methoxyphenyl)amino]-1-phenethyl-pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-4-(3-methoxyanilino)-1-phenethyl-pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-4-(3-methoxyanilino)-1-phenethylpyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-4-(3-methoxyanilino)-1-phenethylpyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-4-(m-anisidino)-1-phenethyl-3-pyrroline-2,5-quinone Formula: C25H21ClN2O3S MolecularWeight: 464.96384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClN2O3S/c1-31-20-9-5-8-19(16-20)27-22-23(32-21-12-10-18(26)11-13-21)25(30)28(24(22)29)15-14-17-6-3-2-4-7-17/h2-13,16,27H,14-15H2,1H3